E203-1112 Screening compound: 4-(2,3-dihydro-1H-indole-1-sulfonyl)-1-methyl-N-(4-sulfamoylphenyl)-1H-pyrrole-2-carboxamide

E203-1112 Screening compound: 4-(2,3-dihydro-1H-indole-1-sulfonyl)-1-methyl-N-(4-sulfamoylphenyl)-1H-pyrrole-2-carboxamide
E203-1112 Screening compound: 4-(2,3-dihydro-1H-indole-1-sulfonyl)-1-methyl-N-(4-sulfamoylphenyl)-1H-pyrrole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E203-1112
4-(2,3-dihydro-1H-indole-1-sulfonyl)-1-methyl-N-(4-sulfamoylphenyl)-1H-pyrrole-2-carboxamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

E203-1112

Molecular Formula

C20H20N4O5S2 (C20 H20 N4 O5 S2)

Compound Name

4-(2,3-dihydro-1H-indole-1-sulfonyl)-1-methyl-N-(4-sulfamoylphenyl)-1H-pyrrole-2-carboxamide

IUPAC name

4-(23-dihydro-1H-indole-1-sulfonyl)-1-methyl-N-(4-sulfamoylphenyl)-1H-pyrrole-2-carboxamide

SMILES

Cn1c(C(Nc(cc2)ccc2S(N)(=O)=O)=O)cc(S(N(CC2)c3c2cccc3)(=O)=O)c1

InChI

InChI=1S/C20H20N4O5S2/c1-23-13-17(31(28,29)24-11-10-14-4-2-3-5-18(14)24)12-19(23)20(25)22-15-6-8-16(9-7-15)30(21,26)27/h2-9,12-13H,10-11H2,1H3,(H,22,25)(H2,21,26,27)

InChI Key

MFKBTTVGDISAPS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14845557

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

460.53

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.354

Distribution Coefficient, logD

1.308

Water Solubility, LogSw

-2.42

Polar Surface Area

107.761

Acid Dissociation Constant (pKa)

8.35

Base Dissociation Constant (pKb)

-3.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.00

E203-1112 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Carbonic Anhydrase II Library (4939 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic
  • PPI modulators

References: we are preparing a list of scientific research reports with E203-1112 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E203-1112?
Check Price and Availability of E203-1112, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of E203-1112 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E203-1112
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E203-1112
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of E203-1112 available by request